RefChem:1060720
TL;DR: RefChem:1060720 (CAS 101710-80-9) is a chemical compound with molecular formula C21H32ClNO3 and molecular weight 381.20706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,2-dimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride
Also Known As: 2-(2,2-Dimethyl-1-pyrrolidinyl)ethyl alpha-cyclopentylmandelate hydrochloride, Pyrrolidine methanol, alpha-isopropyl-, alpha-cyclopentylmandelate hydrochloride, Mandelic acid, alpha-cyclopentyl-, 2-(2,2-dimethyl-1-pyrrolidinyl)ethyl ester, hydrochloride, 1-(2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}ethyl)-2,2-dimethylpyrrolidinium chloride, 2-(2,2-dimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride
Technical Specifications
| Molecular Formula | C21H32ClNO3 |
| Molecular Weight | 381.20706 g/mol |
| XLogP | -0.93 |
| Topological Polar Surface Area (TPSA) | 51.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.20706 Da |
| Heavy Atoms | 26 |
| Complexity | 452.0 |
| SMILES | CC1(CCC[NH+]1CCOC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)C.[Cl-] |
| InChIKey | GSAAOERVBHYCMM-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1060720
Property Insights of RefChem:1060720
The XLogP value of -0.93 indicates that RefChem:1060720 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.0 Ų, RefChem:1060720 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1060720 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1060720?
The CAS number of RefChem:1060720 is 101710-80-9.
What is the molecular formula of RefChem:1060720?
The molecular formula of RefChem:1060720 is C21H32ClNO3.
What is the molecular weight of RefChem:1060720?
The molecular weight of RefChem:1060720 is 381.20706 g/mol.
Where can I buy RefChem:1060720?
You can request a quote for RefChem:1060720 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1060720?
Yes, CoreyChem provides custom synthesis services for RefChem:1060720 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.